N-[(1,3-diphenylpyrazol-4-yl)methyl]-2,3,5,6-tetramethyl-benzenesulfonamide

Systemtic Name: N-[(1,3-diphenylpyrazol-4-yl)methyl]-2,3,5,6-tetramethyl-benzenesulfonamide Openeye Name: N-[(1,3-diphenylpyrazol-4-yl)methyl]-2,3,5,6-tetramethyl-benzenesulfonamide CAS Name: N-[(1,3-diphenyl-4-pyrazolyl)methyl]-2,3,5,6-tetramethylbenzenesulfonamide IUPAC Name: N-[(1,3-diphenylpyrazol-4-yl)methyl]-2,3,5,6-tetramethylbenzenesulfonamide Traditional Name: N-[(1,3-diphenylpyrazol-4-yl)methyl]-2,3,5,6-tetramethyl-benzenesulfonamide Formula: C26H27N3O2S MolecularWeight: 445.57648

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1C)S(=O)(=O)NCC2=CN(N=C2C3=CC=CC=C3)C4=CC=CC=C4)C)C

Isomeric SMILES

CC1=CC(=C(C(=C1C)S(=O)(=O)NCC2=CN(N=C2C3=CC=CC=C3)C4=CC=CC=C4)C)C

InChI

InChI=1S/C26H27N3O2S/c1-18-15-19(2)21(4)26(20(18)3)32(30,31)27-16-23-17-29(24-13-9-6-10-14-24)28-25(23)22-11-7-5-8-12-22/h5-15,17,27H,16H2,1-4H3